methyl 2-ethanoyl-4-(4-methoxyphenyl)-3,4-dihydropyrazole-5-carboxylate

Systemtic Name: methyl 2-ethanoyl-4-(4-methoxyphenyl)-3,4-dihydropyrazole-5-carboxylate Openeye Name: methyl 2-acetyl-4-(4-methoxyphenyl)-3,4-dihydropyrazole-5-carboxylate CAS Name: 2-acetyl-4-(4-methoxyphenyl)-3,4-dihydropyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-acetyl-4-(4-methoxyphenyl)-3,4-dihydropyrazole-5-carboxylate Traditional Name: 1-acetyl-4-(4-methoxyphenyl)-2-pyrazoline-3-carboxylic acid methyl ester Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(C(=N1)C(=O)OC)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(=O)N1CC(C(=N1)C(=O)OC)C2=CC=C(C=C2)OC

InChI

InChI=1S/C14H16N2O4/c1-9(17)16-8-12(13(15-16)14(18)20-3)10-4-6-11(19-2)7-5-10/h4-7,12H,8H2,1-3H3